{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2116183e-10 2.3383745e-10 2.7849925e-10 ] [ 2.8276764e-10 1.4070215e-10 4.6869998e-10 ] [ 2.5771223e-10 4.511133100000001e-10 2.8863541e-10 ] [ 1.8626517e-10 3.4099852e-10 4.680821e-10 ] [ 4.138484e-10 1.2703609e-10 2.8967586e-10 ] [ 3.9836588e-10 3.1887277e-10 1.7838343e-10 ] [ 3.9439446e-10 3.176854e-10 3.9891594e-10 ] ] "source-value" [ [ 2.2116183 2.3383745 2.7849925 ] [ 2.8276764 1.4070215 4.6869998 ] [ 2.5771223 4.5111331 2.8863541 ] [ 1.8626517 3.4099852 4.680821 ] [ 4.138484 1.2703609 2.8967586 ] [ 3.9836588 3.1887277 1.7838343 ] [ 3.9439446 3.176854 3.9891594 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.900146504481025e-11 -4.91563809027648e-12 -1.17583742200512e-11 ] [ -4.6719470262528e-12 1.39301246295456e-11 1.135078048771968e-11 ] [ -3.86989740988032e-12 3.84522388992e-15 4.30392705645504e-12 ] [ -1.27581324314304e-12 1.67619718068096e-12 5.0412487373472e-12 ] [ -1.29367751246496e-11 2.785592338221504e-11 -1.8352933191264e-12 ] [ -1.097298724053504e-11 -6.33869136487104e-12 1.321907864523456e-11 ] [ -5.27404500034944e-12 -3.221192117884609e-11 -2.03212071699168e-11 ] ] "source-value" [ [ 0.0243428 -0.0030681 -0.007339 ] [ -0.002916 0.0086945 0.0070846 ] [ -0.0024154 2.4e-06 0.0026863 ] [ -0.0007963 0.0010462 0.0031465 ] [ -0.0080745 0.0173863 -0.0011455 ] [ -0.0068488 -0.0039563 0.0082507 ] [ -0.0032918 -0.0201051 -0.0126835 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.383888246353378e-18 "source-value" -52.328115 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.176135966883631e-09 1.065338969453006e-08 1.493770787154079e-09 ] [ -3.911289242334533e-08 -4.64419840063888e-08 5.284897664125753e-09 ] [ -1.544808604062649e-09 -1.440547344986478e-08 3.213526023189404e-09 ] [ 1.270340960829399e-08 -7.112450707779406e-09 -5.83405812049454e-09 ] [ -6.906200268336552e-09 5.779049469048979e-09 2.214915450923683e-09 ] [ -2.193017061088251e-09 -2.864395875968538e-09 1.236326382669192e-08 ] [ 3.08773726214375e-08 5.439186487642249e-08 -1.87363156315903e-08 ] ] "source-value" [ [ 3.8548409 6.6493229 0.9323384 ] [ -24.4123475 -28.9868067 3.2985737 ] [ -0.9641937 -8.9911894 2.0057252 ] [ 7.9288447 -4.4392426 -3.6413327 ] [ -4.3105112 3.606999 1.3824415 ] [ -1.3687736 -1.7878153 7.7165424 ] [ 19.2721403 33.9487321 -11.6942885 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.317922049069007e-18 "source-value" -33.191859 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] } "instance-id" 1 }